6J85

Crystal structure of HinD apo

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSRRC BEAMLINE TPS 05A
Synchrotron site	NSRRC
Beamline	TPS 05A
Temperature [K]	100
Detector technology	CCD
Collection date	2018-08-30
Detector	RAYONIX MX300-HS
Wavelength(s)	1.0000
Spacegroup name	P 1 21 1
Unit cell lengths	49.356, 152.647, 56.394
Unit cell angles	90.00, 115.85, 90.00

Refinement procedure

Resolution	48.157 - 2.200
R-factor	0.1819
Rwork	0.170
R-free	0.22600
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6j82
RMSD bond length	0.008
RMSD bond angle	0.982
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.160	2.270
High resolution limit [Å]	2.200	2.200
Rmerge	0.118	0.629
Number of reflections	37990	3318
<I/σ(I)>	8.5	2.1
Completeness [%]	99.9	99.9
Redundancy	3.9	3.9
CC(1/2)	0.993	0.652

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	100 mM MES (pH 6.5) containing 1200 mM (NH4)2HPO4 and 100 mM NaCl